2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethanoate

Systemtic Name: 2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethanoate Openeye Name: 2-(4-methylsulfonyl-2-nitro-anilino)acetate CAS Name: 2-(4-methylsulfonyl-2-nitroanilino)acetate IUPAC Name: 2-(4-methylsulfonyl-2-nitroanilino)acetate Traditional Name: 2-(4-mesyl-2-nitro-anilino)acetate Formula: C9H9N2O6S- MolecularWeight: 273.24256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H10N2O6S/c1-18(16,17)6-2-3-7(10-5-9(12)13)8(4-6)11(14)15/h2-4,10H,5H2,1H3,(H,12,13)/p-1